2-methylpropyl 4-methyl-2-[4-(2-methylpropoxy)-3-nitro-phenyl]-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 4-methyl-2-[4-(2-methylpropoxy)-3-nitro-phenyl]-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-(4-isobutoxy-3-nitro-phenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[4-(2-methylpropoxy)-3-nitrophenyl]-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-methyl-2-[4-(2-methylpropoxy)-3-nitrophenyl]-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-isobutoxy-3-nitro-phenyl)-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=C(C=C2)OCC(C)C)[N+](=O)[O-])C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=C(C=C2)OCC(C)C)[N+](=O)[O-])C(=O)OCC(C)C

InChI

InChI=1S/C19H24N2O5S/c1-11(2)9-25-16-7-6-14(8-15(16)21(23)24)18-20-13(5)17(27-18)19(22)26-10-12(3)4/h6-8,11-12H,9-10H2,1-5H3